Re: [AMBER] Problems with mm_pbsa tests

From: David A Case <david.case.rutgers.edu>
Date: Fri, 15 Oct 2021 08:01:30 -0400

On Thu, Oct 14, 2021, Ravi Abrol wrote:
>
>I ran the test.mmpbsa and it was successful. It seems to delete the output
>files after comparing with reference output.
>Is there a flag to not delete them, so that I can see all the files my test
>generated?

You have to go into the test scripts themselves, and add the "-k" flag to
the invocations of dacdif. This will keep all your files.

But if the tests pass, the files that were deleted will be identical to the
ones with a ".save" or ".check" extension, except for lines starting with
"|".

....dac


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Received on Fri Oct 15 2021 - 05:30:02 PDT
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